CC(C)(C)C(=O)CCl
CAS: 13547-70-1
الاسم: 1-chloro-3,3-dimethylbutan-2-one
SMILES: CC(C)(C)C(=O)CCl

Molecular Processing

Molecular formula
C6H11ClO
Molecular weight
134.61
Exact mass
134.0498
XLogP
1.84
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
35.18

Supplementary Information

InChIKey: ULSAJQMHTGKPIY-UHFFFAOYSA-N
مرادفات
1-Chloropinacolone13547-70-11-Chloro-3,3-dimethyl-2-butanone1-Monochloropinacolinetert-Butyl chloromethyl ketonealpha-ChloropinacolinChloromethyl tert-butyl ketoneDTXSID8027749Z6QD905NNWDTXCID907749monochloropinacolinRefChem:76424236-920-61-Chloro-3,3-dimethylbutan-2-one2-Butanone, 1-chloro-3,3-dimethyl-1-Chloropinacolinalpha-Chloropinacoline1-Chloro-3,3-dimethyl-butan-2-one.alpha.-ChloropinacoloneMFCD00035688ChlorpinakolinChloropinacolineCAS-13547-70-1EINECS 236-920-6UNII-Z6QD905NNWchloropinacolonealpha-Chloropinacolone1-Chloropinacolone, 95%SCHEMBL204096.ALPHA.-CHLOROPINACOLIN
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